N-[(3-chloranyl-4-methyl-phenyl)methyl]-7-isocyano-4-phenyl-phthalazin-1-amine

Systemtic Name: N-[(3-chloranyl-4-methyl-phenyl)methyl]-7-isocyano-4-phenyl-phthalazin-1-amine Openeye Name: N-[(3-chloro-4-methyl-phenyl)methyl]-7-isocyano-4-phenyl-phthalazin-1-amine CAS Name: N-[(3-chloro-4-methylphenyl)methyl]-7-isocyano-4-phenyl-1-phthalazinamine IUPAC Name: N-[(3-chloro-4-methylphenyl)methyl]-7-isocyano-4-phenylphthalazin-1-amine Traditional Name: (3-chloro-4-methyl-benzyl)-(7-isocyano-4-phenyl-phthalazin-1-yl)amine Formula: C23H17ClN4 MolecularWeight: 384.86088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=C(C=C3)[N+]#[C-])C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=C(C=C3)[N+]#[C-])C4=CC=CC=C4)Cl

InChI

InChI=1S/C23H17ClN4/c1-15-8-9-16(12-21(15)24)14-26-23-20-13-18(25-2)10-11-19(20)22(27-28-23)17-6-4-3-5-7-17/h3-13H,14H2,1H3,(H,26,28)